2-[2-decoxy-5-(4-methoxycarbonylphenyl)carbonyl-phenyl]ethanoic acid

Systemtic Name: 2-[2-decoxy-5-(4-methoxycarbonylphenyl)carbonyl-phenyl]ethanoic acid Openeye Name: 2-[2-decoxy-5-(4-methoxycarbonylbenzoyl)phenyl]acetic acid CAS Name: 2-[2-decoxy-5-[(4-methoxycarbonylphenyl)-oxomethyl]phenyl]acetic acid IUPAC Name: 2-[2-decoxy-5-(4-methoxycarbonylbenzoyl)phenyl]acetic acid Traditional Name: 2-[5-(4-carbomethoxybenzoyl)-2-decoxy-phenyl]acetic acid Formula: C27H34O6 MolecularWeight: 454.55526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OC)CC(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OC)CC(=O)O

InChI

InChI=1S/C27H34O6/c1-3-4-5-6-7-8-9-10-17-33-24-16-15-22(18-23(24)19-25(28)29)26(30)20-11-13-21(14-12-20)27(31)32-2/h11-16,18H,3-10,17,19H2,1-2H3,(H,28,29)